SCHEMBL3946396

SCHEMBL3946396

O=C(O)NCCC1CCN(Cc2cccc3ccccc23)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
FAAH O00519 1/20 0.53
SIGMAR1 Q99720 2/20 0.53
DRD4 P21917 1/20 0.53
CHRM4 P08173 1/20 0.52
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51
BCHE P06276 1/20 0.51
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23751044 0.83 MEN1 (0.62) ACHEHDAC1HDAC8HDAC6MEN1
SCHEMBL2979063 0.81 OPRM1 (0.51) ACHEHDAC1HDAC8HDAC6MEN1
SCHEMBL3945816 0.81 CXCR4 (0.59) ACHECHRM4
SCHEMBL3946467 0.79 ACHE (0.52) ACHECHRM4
SCHEMBL3946379 0.79 MCHR1 (0.63) ACHESIGMAR1
SCHEMBL8207838 0.78 ACHE (0.65) ACHEHDAC1HDAC8HDAC6MEN1
SCHEMBL3937456 0.77 CHRM4 (0.68) ACHECHRM4
SCHEMBL3938247 0.76 HTR1A (0.53) SIGMAR1DRD4SLC6A4HTR2A
SCHEMBL1728813 0.75 SIRT2 (0.51) ACHEDRD4CHRM4HTR2C
SCHEMBL4509983 0.75 ACHE (0.68) ACHEHDAC1HDAC8HDAC6MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP claimed
EP-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP disclosed
EP-1720550-A1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005089759-A1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed